3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-hydroxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-hydroxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-hydroxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-[(4-hydroxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-[(4-hydroxyphenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-2-(4-hydroxybenzyl)-3,4-dihydroisocarbostyril Formula: C35H37N3O2 MolecularWeight: 531.68718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4CC5=CC=CC=C5C(=O)N4CC6=CC=C(C=C6)O

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4CC5=CC=CC=C5C(=O)N4CC6=CC=C(C=C6)O

InChI

InChI=1S/C35H37N3O2/c39-31-17-15-27(16-18-31)26-38-34(25-30-13-7-8-14-33(30)35(38)40)37-23-21-36(22-24-37)20-19-32(28-9-3-1-4-10-28)29-11-5-2-6-12-29/h1-18,32,34,39H,19-26H2